Compound Identification
SMILES
COCC1=C2CCN=C2N(N1)C1=CC(Cl)=C(C)C=C1
InChIKey
InChIKey=NZJNCRAJNPHARI-UHFFFAOYSA-N
Formula
C14H16ClN3O
Mass
277.75
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrrolopyrazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolopyrazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolopyrazoles
Alternative Parents
Toluenes Chlorobenzenes Imidolactams Aryl chlorides Pyrrolines Pyrazolines Amidrazones Propargyl-type 1,3-dipolar organic compounds Dialkyl ethers Azacyclic compounds Amidines Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolopyrazole - Chlorobenzene - Halobenzene - Toluene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Imidolactam - Benzenoid - Pyrroline - Pyrazoline - Carboxylic acid amidrazone - Amidine - Azacycle - Organic 1,3-dipolar compound - Dialkyl ether - Ether - Propargyl-type 1,3-dipolar organic compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolopyrazoles. These are polycyclic aromatic compounds containing a pyrrole fused to a pyrazole ring. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyrazole is a 5-membered ring consisting of three carbon atoms and two adjacent nitrogen centers.
External Descriptors
Not available